Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 5/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hexane SCHEMBL8099313 | 1.00 | TSHR (0.64) | TSHRSMN1; SMN2LMNAALDH1A1HSD17B10 | |
| Heptane SCHEMBL11043045 | 0.97 | TSHR (0.60) | TSHRSMN1; SMN2LMNAALDH1A1HSD17B10 | |
| Decane SCHEMBL5449023 | 0.97 | TSHR (0.60) | TSHRSMN1; SMN2LMNAALDH1A1HSD17B10 | |
| Octane SCHEMBL27973378 | 0.97 | TSHR (0.60) | TSHRSMN1; SMN2LMNAALDH1A1HSD17B10 | |
| Heptane SCHEMBL23751339 | 0.94 | TSHR (0.56) | TSHRSMN1; SMN2LMNAALDH1A1HSD17B10 | |
| Isobutanol SCHEMBL27914538 | 0.93 | TSHR (0.64) | TSHRSMN1; SMN2LMNAALDH1A1HSD17B10 | |
| 1-Pentanol SCHEMBL2917883 | 0.91 | SMN1; SMN2 (0.71) | TSHRSMN1; SMN2LMNAALDH1A1HSD17B10 | |
| Octanol SCHEMBL18986690 | 0.88 | LMNA (0.72) | TSHRSMN1; SMN2LMNAALDH1A1HSD17B10 | |
| 1-Hexanol SCHEMBL8415693 | 0.88 | LMNA (0.72) | TSHRSMN1; SMN2LMNAALDH1A1HSD17B10 | |
| Isobutanol SCHEMBL1128320 | 0.87 | ALDH1A1 (0.69) | TSHRSMN1; SMN2LMNAALDH1A1HSD17B10 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8222458-B2 | Process or synthesis of (3S)- and (3R)-3-hydroxy-beta-ionone, and their transformation to zeaxanthin and beta-cryptoxanthin | UNIVERSITY OF MARYLAND, COLLEGE PARK (US) | 2012-07-17 | — | — | US | disclosed |
| US-20090311761-A1 | Process for Synthesis of (3S)- and (3R)-3-Hydroxy-Beta-Ionone, and Their Transformation to Zeaxanthin and Beta-Cryptoxanthin | UNIVERSITY OF MARYLAND, COLLEGE PARK | 2009-12-17 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20090311761-A1 | Process for Synthesis of (3S)- and (3R)-3-Hydroxy-Beta-Ionone, and Their Transformation to Zeaxanthin and Beta-Cryptoxanthin | GRK1, HSD3B1, ALDH1A2 | TSHR 2720/4885SMN1; SMN2 3091/4885LMNA 118/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.